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102185-34-2 | 1-Pyrrolidinecarboxylic acid, 2-[[(2,5-dioxo-1-pyrrolidinyl)oxy]carbonyl]-, 1,1-dimethylethyl ester, (2R)-
CAS No: 102185-34-2 Catalog No: AG0006U9 MDL No:MFCD00069687
Product Description
Catalog Number:
AG0006U9
Chemical Name:
1-Pyrrolidinecarboxylic acid, 2-[[(2,5-dioxo-1-pyrrolidinyl)oxy]carbonyl]-, 1,1-dimethylethyl ester, (2R)-
CAS Number:
102185-34-2
Molecular Formula:
C14H20N2O6
Molecular Weight:
312.3184
MDL Number:
MFCD00069687
IUPAC Name:
1-O-tert-butyl 2-O-(2,5-dioxopyrrolidin-1-yl) (2R)-pyrrolidine-1,2-dicarboxylate
InChI:
InChI=1S/C14H20N2O6/c1-14(2,3)21-13(20)15-8-4-5-9(15)12(19)22-16-10(17)6-7-11(16)18/h9H,4-8H2,1-3H3/t9-/m1/s1
InChI Key:
DICWIJISMKZDDY-SECBINFHSA-N
SMILES:
O=C([C@H]1CCCN1C(=O)OC(C)(C)C)ON1C(=O)CCC1=O
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
312.132g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.322g/mol
Monoisotopic Mass:
312.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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